2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine

C19H22ClNO3 — CID 77271449

IUPAC2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine
SMILESCOc1ccc(CN2CCOC(c3ccc(Cl)cc3)C2)c(OC)c1
InChIInChI=1S/C19H22ClNO3/c1-22-17-8-5-15(18(11-17)23-2)12-21-9-10-24-19(13-21)14-3-6-16(20)7-4-14/h3-8,11,19H,9-10,12-13H2,1-2H3
InChIKeyWACFOBVEMPNCEG-UHFFFAOYSA-N
MW347.84 g/mol
LogP3.93
Rot. Bonds5

About 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine

2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine (PubChem CID 77271449) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine
PubChem CID77271449
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC Name2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine
SMILESCOc1ccc(CN2CCOC(c3ccc(Cl)cc3)C2)c(OC)c1
InChIInChI=1S/C19H22ClNO3/c1-22-17-8-5-15(18(11-17)23-2)12-21-9-10-24-19(13-21)14-3-6-16(20)7-4-14/h3-8,11,19H,9-10,12-13H2,1-2H3
InChIKeyWACFOBVEMPNCEG-UHFFFAOYSA-N
XLogP3.93
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2,4-dimethoxyphenyl)methyl]-2-(4-nitrophenyl)morpholine
CID 77271766
(2R)-4-[(2,4-dimethoxyphenyl)methyl]-2-(4-phenylmethoxyphenyl)morpholine
CID 67352745
[4-[(2S)-4-[(2,4-dimethoxyphenyl)methyl]morpholin-2-yl]phenyl] 4-methylbenzenesulfonate
CID 87367870
4-[(2-fluoro-4,5-dimethoxyphenyl)methyl]-2-phenylmorpholine
CID 74237175
2-[4-(4-chlorophenoxy)phenyl]-4-ethylmorpholine
CID 142654768
(2S)-2-benzyl-4-[(2,4-dimethoxyphenyl)methyl]morpholine
CID 29024699
(2R)-2-(4-bromophenyl)-4-[(4-methoxyphenyl)methyl]morpholine
CID 67351459
1-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]piperazine
CID 6456141
2-[[(2R)-2-(4-fluorophenyl)morpholin-4-yl]methyl]-4,5-dimethoxyphenol
CID 97063266
methyl 2-[4-[[2-(4-chlorophenyl)morpholin-4-yl]methyl]phenoxy]acetate
CID 56878101
2-isoquinolin-3-yl-4-[(2-methoxyphenyl)methyl]morpholine
CID 110218627
(2S)-4-[(4-methoxyphenyl)methyl]-2-(4-phenylmethoxyphenyl)morpholine
CID 67352433

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine?
The IUPAC name of 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine (CID 77271449) is 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine.
What is the SMILES notation for 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine?
The canonical SMILES for 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine is COc1ccc(CN2CCOC(c3ccc(Cl)cc3)C2)c(OC)c1.
What is the InChIKey of 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine?
The InChIKey is WACFOBVEMPNCEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-22-17-8-5-15(18(11-17)23-2)12-21-9-10-24-19(13-21)14-3-6-16(20)7-4-14/h3-8,11,19H,9-10,12-13H2,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine?
2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine has a molecular weight of 347.84 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-[(2,4-dimethoxyphenyl)methyl]morpholine is sourced from PubChem (CID 77271449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).